Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 18/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6970129 | 0.93 | S1PR3 (0.40) | S1PR3ALDH1A1NTRK1 | |
| SCHEMBL6973222 | 0.92 | S1PR3 (0.41) | S1PR3ALDH1A1NTRK1 | |
| SCHEMBL7082911 | 0.90 | ALDH1A1 (0.40) | S1PR3ALDH1A1 | |
| SCHEMBL6962934 | 0.89 | MEN1 (0.39) | S1PR3ALDH1A1 | |
| SCHEMBL6960222 | 0.88 | S1PR3 (0.36) | S1PR3NTRK1 | |
| SCHEMBL7084640 | 0.87 | S1PR3 (0.39) | S1PR3ALDH1A1 | |
| SCHEMBL7085418 | 0.86 | POLB (0.38) | S1PR3ALDH1A1 | |
| SCHEMBL7078209 | 0.86 | S1PR3 (0.34) | S1PR3ALDH1A1 | |
| SCHEMBL6973511 | 0.86 | S1PR3 (0.36) | S1PR3ALDH1A1 | |
| SCHEMBL7080069 | 0.86 | S1PR3 (0.37) | S1PR3ALDH1A1NTRK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0786455-B1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO (JP) | 2003-12-03 | — | — | EP | disclosed |
| US-6147097-A | METHOD FOR TREATING AIDS | SHIONOGI & CO., LTD. (JP) | 2000-11-14 | — | — | US | disclosed |
| US-5910506-A | IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC | SHIONOGI & CO., LTD. (JP) | 1999-06-08 | — | — | US | disclosed |
| EP-0786455-A1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1997-07-30 | — | — | EP | disclosed |